methyl (Z)-2-cyano-3-(4-methoxyphenyl)prop-2-enoate
TL;DR: methyl (Z)-2-cyano-3-(4-methoxyphenyl)prop-2-enoate (CAS 151887-72-8) is a chemical compound with molecular formula C12H11NO3 and molecular weight 217.0739 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl (Z)-2-cyano-3-(4-methoxyphenyl)prop-2-enoate
Also Known As: methyl 2-cyano-3-(4-methoxyphenyl)prop-2-enoate, Methyl 2-cyano-3-(4-methoxyphenyl)acrylate, BAS 00163954, BIM-0018925.P001, Methyl trans-alpha-cyano-4-methoxycinnamate
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H11NO3 |
| Molecular Weight | 217.0739 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 59.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 217.0739 Da |
| Heavy Atoms | 16 |
| Complexity | 318.0 |
| SMILES | COC1=CC=C(C=C1)/C=C(/C#N)\C(=O)OC |
| InChIKey | MCFCPVVFVXSZSK-YFHOEESVSA-N |
Chemical Property Profile of methyl (Z)-2-cyano-3-(4-methoxyphenyl)prop-2-enoate
Property Insights of methyl (Z)-2-cyano-3-(4-methoxyphenyl)prop-2-enoate
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl (Z)-2-cyano-3-(4-methoxyphenyl)prop-2-enoate. With a topological polar surface area (TPSA) of 59.3 Ų, methyl (Z)-2-cyano-3-(4-methoxyphenyl)prop-2-enoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl (Z)-2-cyano-3-(4-methoxyphenyl)prop-2-enoate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of methyl (Z)-2-cyano-3-(4-methoxyphenyl)prop-2-enoate?
The CAS number of methyl (Z)-2-cyano-3-(4-methoxyphenyl)prop-2-enoate is 151887-72-8.
What is the molecular formula of methyl (Z)-2-cyano-3-(4-methoxyphenyl)prop-2-enoate?
The molecular formula of methyl (Z)-2-cyano-3-(4-methoxyphenyl)prop-2-enoate is C12H11NO3.
What is the molecular weight of methyl (Z)-2-cyano-3-(4-methoxyphenyl)prop-2-enoate?
The molecular weight of methyl (Z)-2-cyano-3-(4-methoxyphenyl)prop-2-enoate is 217.0739 g/mol.
Where can I buy methyl (Z)-2-cyano-3-(4-methoxyphenyl)prop-2-enoate?
You can request a quote for methyl (Z)-2-cyano-3-(4-methoxyphenyl)prop-2-enoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for methyl (Z)-2-cyano-3-(4-methoxyphenyl)prop-2-enoate?
Yes, CoreyChem provides custom synthesis services for methyl (Z)-2-cyano-3-(4-methoxyphenyl)prop-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.